SCHEMBL4448853

SCHEMBL4448853

CCC[C@@H]1O[C@@H]2C[C@H]3[C@@H]4CCC5=CC(=O)C=C[C@]5(C)[C@H]4[C@@H](O)C[C@]3(C)[C@]2(C(=O)COC(=O)O)O1

nearest known ligand 0.83

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NR3C1 P04150 10/20 0.82
▸ PGR P06401 7/20 0.82
▸ HIF1A Q16665 4/20 0.82
▸ CYP3A4 P08684 3/20 0.82
▸ LMNA P02545 2/20 0.82
▸ ABCC3 O15438 1/20 0.82
▸ ABCC4 O15439 1/20 0.82
▸ ABCB11 O95342 1/20 0.82
▸ IL5 P05113 1/20 0.82
▸ NR3C2 P08235 1/20 0.82
▸ AR P10275 1/20 0.82
▸ CHRM1 P11229 1/20 0.82
▸ MMP9 P14780 1/20 0.82
▸ NFKB1 P19838 1/20 0.82
▸ THPO P40225 1/20 0.82
▸ SMN1; SMN2 Q16637 1/20 0.82
▸ HSD17B10 Q99714 1/20 0.82
▸ BLM P54132 1/20 0.82
▸ PMP22 Q01453 1/20 0.82
▸ NPSR1 Q6W5P4 1/20 0.82

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL17151413 0.94 ALDH1A1 (0.84) NR3C1PGRHIF1ACYP3A4LMNA
SCHEMBL7735898 0.94 ALDH1A1 (0.84) NR3C1PGRHIF1ACYP3A4LMNA
SCHEMBL7751385 0.94 ALDH1A1 (0.84) NR3C1PGRHIF1ACYP3A4LMNA
SCHEMBL5396842 0.93 NR3C1 (0.81) NR3C1PGRHIF1ACYP3A4LMNA
SCHEMBL13368103 0.93 NR3C1 (0.84) NR3C1PGRHIF1ACYP3A4LMNA
SCHEMBL13491403 0.93 NR3C1 (0.84) NR3C1PGRHIF1ACYP3A4LMNA
SCHEMBL13524508 0.93 NR3C1 (0.84) NR3C1PGRHIF1ACYP3A4LMNA
SCHEMBL26227694 0.93 NR3C1 (0.84) NR3C1PGRHIF1ACYP3A4LMNA
SCHEMBL27106939 0.93 NR3C1 (0.84) NR3C1PGRHIF1ACYP3A4LMNA
SCHEMBL21153523 0.92 NR3C1 (0.77) NR3C1PGRHIF1ACYP3A4LMNA

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 14 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024037644-A1 PEG-MODIFIED GLUCOCORTICOID MEDICAMENT AND USE THEREOF 津药生物科技(天津)有限公司 2024-02-22 — — WO disclosed
US-8710036-B2 Carbonate and carbamate modified forms of glucocorticoids in combination with β2 adrenergic agonists SUNOVION PHARMACEUTICALS INC. (US) 2014-04-29 — — US disclosed
US-20130244988-A1 CARBONATE AND CARBAMATE MODIFIED FORMS OF GLUCOCORTICOIDS IN COMBINATION WITH B2 ADRENERGIC AGONISTS SUNOVION PHARMACEUTICALS INC. (US) 2013-09-19 — — US disclosed
US-8445470-B2 Carbonate and carbamate modified forms of glucocorticoids in combination with B2 adrenergic agonists SUNOVION PHARMACEUTICALS INC. (US) 2013-05-21 — — US disclosed
US-20090163456-A1 CARBONATE AND CARBAMATE MODIFIED FORMS OF GLUCOCORTICOIDS IN COMBINATION WITH B2 ADRENERGIC AGONISTS SEPRACOR INC. (US) 2009-06-25 — — US disclosed
US-7468362-B2 Carbonate and carbamate modified forms of glucocorticoids in combination with β2 adrenergic agonists SEPRACOR INC. (US) 2008-12-23 — — US disclosed
US-20080103119-A1 CARBONATE AND CARBAMATE MODIFIED FORMS OF GLUCOCORTICOIDS IN COMBINATION WITH B2 ADRENERGIC AGONISTS SEPRACOR INC. (US) 2008-05-01 — — US disclosed
US-7253156-B2 Carbonate and carbamate modified forms of glucocorticoids in combination with B2 adrenergic agonists SEPRACOR INC. (US) 2007-08-07 — — US disclosed
US-20060148775-A1 Carbonate and carbamate modified forms of glucocorticoids in combination with B2 adrenergic agonists SEPRACOR INC. (US) 2006-07-06 — — US disclosed
US-7018995-B2 Carbonate and carbamate modified forms of glucocorticoids SEPRACOR INC. (US) 2006-03-28 — — US disclosed
US-20050009798-A1 Carbonate and carbamate modified forms of glucocorticoids in combination with B2 adrenergic agonists SEPRACOR INC. (US) 2005-01-13 — — US disclosed
WO-2004047845-A1 CARBONATE AND CARBAMATE MODIFIED FORMS OF GLUCOCORTICOIDS IN COMBINATION WITH β2 ADRENERGIC AGONISTS SEPRACOR INC. (US) 2004-06-10 — — WO disclosed
US-20030176407-A1 Carbonate and carbamate modified forms of glucocorticoids SEPRACOR INC. (US) 2003-09-18 — — US disclosed
WO-2003070745-A2 CARBONATE AND CARBAMATE MODIFIED FORMS OF GLUCOCORTICOIDS SEPRACOR INC. (US) 2003-08-28 — — WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (6 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20060148775-A1 Carbonate and carbamate modified forms of glucocorticoids in combination with B2 adrenergic agonists ADRB2, ADRA2C, NR3C2 NR3C1 12/4885PGR 449/4885HIF1A 665/4885
US-20080103119-A1 CARBONATE AND CARBAMATE MODIFIED FORMS OF GLUCOCORTICOIDS IN COMBINATION WITH B2 ADRENERGIC AGONISTS ADRB2, ADRA2C, NR3C2 NR3C1 12/4885PGR 449/4885HIF1A 665/4885
US-20130244988-A1 CARBONATE AND CARBAMATE MODIFIED FORMS OF GLUCOCORTICOIDS IN COMBINATION WITH B2 ADRENERGIC AGONISTS ADRB2, CHRM2, NR3C2 NR3C1 10/4885PGR 443/4885HIF1A 593/4885
US-20090163456-A1 CARBONATE AND CARBAMATE MODIFIED FORMS OF GLUCOCORTICOIDS IN COMBINATION WITH B2 ADRENERGIC AGONISTS ADRB2, CHRM2, NR3C2 NR3C1 10/4885PGR 443/4885HIF1A 593/4885
US-20030176407-A1 Carbonate and carbamate modified forms of glucocorticoids NR3C1, NR5A1, NR3C2 NR3C1 1/4885PGR 753/4885HIF1A 671/4885
US-20050009798-A1 Carbonate and carbamate modified forms of glucocorticoids in combination with B2 adrenergic agonists ADRB2, ADRA2C, NR3C2 NR3C1 12/4885PGR 449/4885HIF1A 665/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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